NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage position program type
515833 1zw7 cing 1-original 3 XPLOR/CNS chemical shift



assign (resid  1     and name c ) (resid  2     and name n )
       (resid  2     and name ca) (resid  2     and name c )
       (resid  3     and name n )                               55.1641  30.5784
assign (resid  2     and name c ) (resid  5     and name n )
       (resid  3     and name ca) (resid  3     and name c )
       (resid  4     and name n )                               59.5252 42.15235
assign (resid  3     and name c ) (resid  4     and name n )
       (resid  4     and name ca) (resid  4     and name c )
       (resid  5     and name n )                               55.1841 41.2812
assign (resid  4     and name c ) (resid  5     and name n )
       (resid  5     and name ca) (resid  5     and name c )
       (resid  6     and name n )                               60.4067 34.9204
assign (resid  5     and name c ) (resid  6     and name n )
       (resid  6     and name ca) (resid  6     and name c )
       (resid  7     and name n )                               54.4171 33.0241
assign (resid  6     and name c ) (resid  7     and name n )
       (resid  7     and name ca) (resid  7     and name c )
       (resid  8     and name n )                               61.0508 69.7481
assign (resid  7     and name c ) (resid  8     and name n )
       (resid  8     and name ca) (resid  8     and name c )
       (resid  9     and name n )                               57.6451 41.7638
assign (resid  8     and name c ) (resid  9     and name n )
       (resid  9     and name ca) (resid  9     and name c )
       (resid  10    and name n )                               61.4829 69.0527
assign (resid  9     and name c ) (resid  10    and name n )
       (resid  10    and name ca) (resid  10    and name c )
       (resid  11    and name n )                               45.1941 $noexpectation
assign (resid  10    and name c ) (resid  11    and name n )
       (resid  11    and name ca) (resid  11    and name c )
       (resid  12    and name n )                               51.9928 19.2213
assign (resid  11    and name c ) (resid  12    and name n )
       (resid  12    and name ca) (resid  12    and name c )
       (resid  13    and name n )                               62.5879 69.4536
assign (resid  12    and name c ) (resid  13    and name n )
       (resid  13    and name ca) (resid  13    and name c )
       (resid  14    and name n )                               59.5378 40.4583
assign (resid  13    and name c ) (resid  14    and name n )
       (resid  14    and name ca) (resid  14    and name c )
       (resid  15    and name n )                               61.8738 69.3878
assign (resid  14    and name c ) (resid  15    and name n )
       (resid  15    and name ca) (resid  15    and name c )
       (resid  16    and name n )                               53.2256 46.7375
assign (resid  15    and name c ) (resid  16    and name n )
       (resid  16    and name ca) (resid  16    and name c )
       (resid  17    and name n )                               54.7429 29.2849
assign (resid  16    and name c ) (resid  17    and name n )
       (resid  17    and name ca) (resid  17    and name c )
       (resid  18    and name n )                               58.5677 35.7280
assign (resid  17    and name c ) (resid  18    and name n )
       (resid  18    and name ca) (resid  18    and name c )
       (resid  19    and name n )                               53.7161 31.3525
assign (resid  18    and name c ) (resid  19    and name n )
       (resid  19    and name ca) (resid  19    and name c )
       (resid  20    and name n )                               62.2802  62.2802
assign (resid  19    and name c ) (resid  20    and name n )
       (resid  20    and name ca) (resid  20    and name c )
       (resid  21    and name n )                               57.4081 63.2900
assign (resid  20    and name c ) (resid  21    and name n )
       (resid  21    and name ca) (resid  21    and name c )
       (resid  22    and name n )                               55.202 40.7236
assign (resid  21    and name c ) (resid  22    and name n )
       (resid  22    and name ca) (resid  22    and name c )
       (resid  23    and name n )                               59.9222 71.2044
assign (resid  22    and name c ) (resid  23    and name n )
       (resid  23    and name ca) (resid  23    and name c )
       (resid  24    and name n )                               62.5525 34.8823
assign (resid  23    and name c ) (resid  24    and name n )
       (resid  24    and name ca) (resid  24    and name c )
       (resid  25    and name n )                               57.0737 40.1064
assign (resid  24    and name c ) (resid  25    and name n )
       (resid  25    and name ca) (resid  25    and name c )
       (resid  26    and name n )                               56.3634 39.0631
assign (resid  25    and name c ) (resid  26    and name n )
       (resid  26    and name ca) (resid  26    and name c )
       (resid  27    and name n )                               67.4279 30.8488
assign (resid  26    and name c ) (resid  27    and name n )
       (resid  27    and name ca) (resid  27    and name c )
       (resid  28    and name n )                               60.3475 32.4653
assign (resid  27    and name c ) (resid  28    and name n )
       (resid  28    and name ca) (resid  28    and name c )
       (resid  29    and name n )                               60.9701 62.7500
assign (resid  28    and name c ) (resid  29    and name n )
       (resid  29    and name ca) (resid  29    and name c )
       (resid  30    and name n )                               57.2959 33.4813
assign (resid  29    and name c ) (resid  30    and name n )
       (resid  30    and name ca) (resid  30    and name c )
       (resid  31    and name n )                               61.7108 38.5192
assign (resid  30    and name c ) (resid  31    and name n )
       (resid  31    and name ca) (resid  31    and name c )
       (resid  32    and name n )                               56.3000 28.5537
assign (resid  31    and name c ) (resid  32    and name n )
       (resid  32    and name ca) (resid  32    and name c )
       (resid  33    and name n )                               52.4796 19.3231
assign (resid  32    and name c ) (resid  33    and name n )
       (resid  33    and name ca) (resid  33    and name c )
       (resid  34    and name n )                               50.1433 18.4208
assign (resid  33    and name c ) (resid  34    and name n )
       (resid  34    and name ca) (resid  34    and name c )
       (resid  35    and name n )                               63.841 31.6788
assign (resid  34    and name c ) (resid  35    and name n )
       (resid  35    and name ca) (resid  35    and name c )
       (resid  36    and name n )                               45.5622  $noexpectation
assign (resid  35    and name c ) (resid  36    and name n )
       (resid  36    and name ca) (resid  36    and name c )
       (resid  37    and name n )                               57.2959 38.0074
assign (resid  37    and name c ) (resid  38    and name n )
       (resid  38    and name ca) (resid  38    and name c )
       (resid  39    and name n )                               65.2286 31.8095
assign (resid  38    and name c ) (resid  39    and name n )
       (resid  39    and name ca) (resid  39    and name c )
       (resid  40    and name n )                               54.9536 39.7780
assign (resid  39    and name c ) (resid  40    and name n )
       (resid  40    and name ca) (resid  40    and name c )
       (resid  41    and name n )                               55.5964 29.2088
assign (resid  40    and name c ) (resid  41    and name n )
       (resid  41    and name ca) (resid  41    and name c )
       (resid  42    and name n )                               54.8879 31.8424
assign (resid  41    and name c ) (resid  42    and name n )
       (resid  42    and name ca) (resid  42    and name c )
       (resid  43    and name n )                               53.6515 32.4604
assign (resid  42    and name c ) (resid  43    and name n )
       (resid  43    and name ca) (resid  43    and name c )
       (resid  44    and name n )                               53.5011 45.5934
assign (resid  43    and name c ) (resid  44    and name n )
       (resid  44    and name ca) (resid  44    and name c )
       (resid  45    and name n )                               58.3893 40.5441
assign (resid  44    and name c ) (resid  45    and name n )
       (resid  45    and name ca) (resid  45    and name c )
       (resid  46    and name n )                               56.6566 43.6093
assign (resid  45    and name c ) (resid  46    and name n )
       (resid  46    and name ca) (resid  46    and name c )
       (resid  47    and name n )                               52.5215 16.5637
assign (resid  46    and name c ) (resid  47    and name n )
       (resid  47    and name ca) (resid  47    and name c )
       (resid  48    and name n )                               45.4025 $noexpectation
assign (resid  47    and name c ) (resid  48    and name n )
       (resid  48    and name ca) (resid  48    and name c )
       (resid  49    and name n )                               54.7488 34.3859
assign (resid  48    and name c ) (resid  49    and name n )
       (resid  49    and name ca) (resid  49    and name c )
       (resid  50    and name n )                               56.1294 28.8416
assign (resid  49    and name c ) (resid  50    and name n )
       (resid  50    and name ca) (resid  50    and name c )
       (resid  51    and name n )                               53.9578 41.2591
assign (resid  50    and name c ) (resid  51    and name n )
       (resid  51    and name ca) (resid  51    and name c )
       (resid  52    and name n )                               56.5336 30.9682
assign (resid  51    and name c ) (resid  52    and name n )
       (resid  52    and name ca) (resid  52    and name c )
       (resid  53    and name n )                               56.7221 30.8931
assign (resid  52    and name c ) (resid  53    and name n )
       (resid  53    and name ca) (resid  53    and name c )
       (resid  54    and name n )                               45.2245  $noexpectation
assign (resid  53    and name c ) (resid  54    and name n )
       (resid  54    and name ca) (resid  54    and name c )
       (resid  55    and name n )                               54.7336 32.283
assign (resid  54    and name c ) (resid  55    and name n )
       (resid  55    and name ca) (resid  55    and name c )
       (resid  56    and name n )                               59.8704 72.081
assign (resid  55    and name c ) (resid  56    and name n )
       (resid  56    and name ca) (resid  56    and name c )
       (resid  57    and name n )                               58.8482 40.3054
assign (resid  56    and name c ) (resid  57    and name n )
       (resid  57    and name ca) (resid  57    and name c )
       (resid  58    and name n )                               60.9505 62.0000
assign (resid  57    and name c ) (resid  58    and name n )
       (resid  58    and name ca) (resid  58    and name c )
       (resid  59    and name n )                               57.1965 39.9593
assign (resid  58    and name c ) (resid  59    and name n )
       (resid  59    and name ca) (resid  59    and name c )
       (resid  60    and name n )                               58.1486 39.8364
assign (resid  59    and name c ) (resid  60    and name n )
       (resid  60    and name ca) (resid  60    and name c )
       (resid  61    and name n )                               53.9706 37.3675
assign (resid  60    and name c ) (resid  61    and name n )
       (resid  61    and name ca) (resid  61    and name c )
       (resid  62    and name n )                               62.071 36.8205
assign (resid  61    and name c ) (resid  62    and name n )
       (resid  62    and name ca) (resid  62    and name c )
       (resid  63    and name n )                               53.6632 31.3023
assign (resid  62    and name c ) (resid  63    and name n )
       (resid  63    and name ca) (resid  63    and name c )
       (resid  64    and name n )                               57.4999 32.6922
assign (resid  63    and name c ) (resid  64    and name n )
       (resid  64    and name ca) (resid  64    and name c )
       (resid  65    and name n )                               57.5207 25.766
assign (resid  64    and name c ) (resid  65    and name n )
       (resid  65    and name ca) (resid  65    and name c )
       (resid  66    and name n )                              60.7962 64.6994
assign (resid  65    and name c ) (resid  66    and name n )
       (resid  66    and name ca) (resid  66    and name c )
       (resid  67    and name n )                               62.429 69.5016
assign (resid  66    and name c ) (resid  67    and name n )
       (resid  67    and name ca) (resid  67    and name c )
       (resid  68    and name n )                               53.9458 44.3115
assign (resid  67    and name c ) (resid  68    and name n )
       (resid  68    and name ca) (resid  68    and name c )
       (resid  69    and name n )                               54.8534 31.1202
assign (resid  68    and name c ) (resid  69    and name n )
       (resid  69    and name ca) (resid  69    and name c )
       (resid  70    and name n )                               54.1958 44.4398
assign (resid  69    and name c ) (resid  70    and name n )
       (resid  70    and name ca) (resid  70    and name c )
       (resid  71    and name n )                               59.4178 35.7011
assign (resid  70    and name c ) (resid  71    and name n )
       (resid  71    and name ca) (resid  71    and name c )
       (resid  72    and name n )                               54.4349 42.7800
assign (resid  71    and name c ) (resid  72    and name n )
       (resid  72    and name ca) (resid  72    and name c )
       (resid  73    and name n )                               55.6878 30.9682
assign (resid  72    and name c ) (resid  73    and name n )
       (resid  73    and name ca) (resid  73    and name c )
       (resid  74    and name n )                               55.4104 42.1380
assign (resid  73    and name c ) (resid  74    and name n )
       (resid  74    and name ca) (resid  74    and name c )
       (resid  75    and name n )                               55.9908 30.7937
assign (resid  74    and name c ) (resid  75    and name n )
       (resid  75    and name ca) (resid  75    and name c )
       (resid  76    and name n )                               45.2488 $noexpectation 
assign (resid  75    and name c ) (resid  76    and name n )
       (resid  76    and name ca) (resid  76    and name c )
       (resid  77    and name n )                               45.1638 $noexpectation
assign (resid  76    and name c ) (resid  77    and name n )
       (resid  77    and name ca) (resid  77    and name c )
       (resid  78    and name n )                               55.1995 28.8329
assign (resid  80    and name c ) (resid  81    and name n )
       (resid  81    and name ca) (resid  81    and name c )
       (resid  82    and name n )                               57.1849 29.4900
OBSE (resid 1 and name HA)  4.099
OBSE (resid 2 and name HA)  5.0697
OBSE (resid 3 and name HA)  4.120
OBSE (resid 4 and name HA)  5.627
OBSE (resid 5 and name HA)  4.713
OBSE (resid 6 and name HA)  5.184
OBSE (resid 7 and name HA)  4.808
OBSE (resid 8 and name HA)  4.191
OBSE (resid 9 and name HA) 4.495
OBSE (resid 10 and name HA#) 4.325
OBSE (resid 11 and name HA) 4.352
OBSE (resid 12 and name HA) 5.007
OBSE (resid 13 and name HA) 4.556
OBSE (resid 14 and name HA) 4.876
OBSE (resid 15 and name HA) 4.653
OBSE (resid 16 and name HA) 4.802
OBSE (resid 17 and name HA) 4.629
OBSE (resid 18 and name HA) 4.756
OBSE (resid 19 and name HA) 3.821
OBSE (resid 20 and name HA) 4.309
OBSE (resid 21 and name HA) 4.599
OBSE (resid 22 and name HA) 4.803
OBSE (resid 23 and name HA) 3.489
OBSE (resid 24 and name HA) 4.190
OBSE (resid 25 and name HA) 4.322
OBSE (resid 26 and name HA) 3.295
OBSE (resid 28 and name HA) 3.684
OBSE (resid 28 and name HA) 4.206
OBSE (resid 29 and name HA) 4.130
OBSE (resid 30 and name HA) 3.824
OBSE (resid 31 and name HA) 4.118
OBSE (resid 32 and name HA) 4.210
OBSE (resid 33 and name HA) 4.237
OBSE (resid 35 and name HA#) 4.009
OBSE (resid 38 and name HA) 4.133
OBSE (resid 39 and name HA) 4.443
OBSE (resid 40 and name HA) 4.336
OBSE (resid 41 and name HA) 4.869
OBSE (resid 42 and name HA) 4.614
OBSE (resid 43 and name HA) 5.164
OBSE (resid 44 and name HA) 4.922
OBSE (resid 45 and name HA) 4.984
OBSE (resid 46 and name HA) 3.599
OBSE (resid 47 and name HA#) 3.377
OBSE (resid 48 and name HA) 4.488
OBSE (resid 49 and name HA) 4.245
OBSE (resid 50 and name HA) 3.995
OBSE (resid 51 and name HA) 4.256
OBSE (resid 52 and name HA) 4.249
OBSE (resid 53 and name HA#) 3.809
OBSE (resid 54 and name HA) 4.580
OBSE (resid 55 and name HA) 5.155
OBSE (resid 56 and name HA) 3.973
OBSE (resid 57 and name HA) 4.183
OBSE (resid 58 and name HA) 4.195
OBSE (resid 59 and name HA) 4.567
OBSE (resid 60 and name HA) 4.256
OBSE (resid 61 and name HA) 3.361
OBSE (resid 62 and name HA) 4.399
OBSE (resid 63 and name HA) 3.977
OBSE (resid 64 and name HA) 3.370
OBSE (resid 65 and name HA) 4.561
OBSE (resid 66 and name HA) 5.246
OBSE (resid 67 and name HA) 5.126
OBSE (resid 68 and name HA) 5.129
OBSE (resid 69 and name HA) 5.136
OBSE (resid 70 and name HA) 4.554
OBSE (resid 71 and name HA) 4.672
OBSE (resid 72 and name HA) 4.199
OBSE (resid 73 and name HA) 4.274
OBSE (resid 74 and name HA) 4.290
OBSE (resid 75 and name HA#) 3.888
OBSE (resid 76 and name HA#) 3.810
OBSE (resid 81 and name HA) 4.570


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